Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | PDE2A | O00408 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 2/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | RORC | P51449 | 1/20 | 0.39 |
| ▸ | RORB | Q92753 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28143221 | 0.80 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2CES2RAB9ACYP2C9 | |
| SCHEMBL28819289 | 0.77 | CYP2C9 (0.43) | MEN1KMT2AALDH1A1MAPTHTT | |
| SCHEMBL28960373 | 0.72 | CYP2C9 (0.64) | MEN1KMT2AALDH1A1MAPTHTT | |
| SCHEMBL2927951 | 0.72 | CYP2C9 (0.50) | MEN1KMT2AALDH1A1MAPTHTT | |
| SCHEMBL28957192 | 0.71 | TAS2R14 (0.46) | MEN1KMT2AALDH1A1MAPTHTT | |
| SCHEMBL3789260 | 0.70 | PDE2A (0.56) | MEN1KMT2AALDH1A1MAPTPDE2A | |
| SCHEMBL3172058 | 0.68 | CES2 (0.55) | MEN1KMT2AALDH1A1MAPTHTT | |
| Bromomethane SCHEMBL3170357 | 0.67 | MAPT (0.51) | MEN1KMT2AALDH1A1MAPTHTT | |
| SCHEMBL11599763 | 0.67 | PDE2A (0.57) | MEN1KMT2AALDH1A1MAPTPDE2A | |
| SCHEMBL11598716 | 0.67 | PDE2A (0.53) | MEN1KMT2AALDH1A1MAPTPDE2A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106715413-B | piperazine derivatives as liver X receptor modulators | VITAE PHARMACEUTICALS, INC. (US) | 2019-11-01 | — | — | CN | disclosed |